Name: Quetiapine-d4 hemifumarate
Rating: 5 (10 reviews)

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HIT ID:HIT214314932
Cas No:1217310-65-0
常用名:Quetiapine-d4 hemifumarate
别名:半富马酸奎硫平 D4
IUPAC:(2E)-but-2-enedioic acid; 2-[2-(4-{2-thia-9-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-10-yl}piperazin-1-yl)(1,1,2,2-2H4)ethoxy]ethan-1-ol
IUPAC:(2E)-but-2-enedioic acid; 2-[2-(4-{2-thia-9-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-10-yl}piperazin-1-yl)(1,1,2,2-2H4)ethoxy]ethan-1-ol
InChI key:VRHJBWUIWQOFLF-QWVIKDOWSA-N

分子式:C25H29N3O6S
分子量:503.61
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:OC(=O)\C=C\C(O)=O.[2H]C([2H])(OCCO)C([2H])([2H])N1CCN(CC1)C1=Nc2ccccc2Sc2ccccc12 |t:24|
SMILES:OC(=O)\C=C\C(O)=O.[2H]C([2H])(OCCO)C([2H])([2H])N1CCN(CC1)C1=Nc2ccccc2Sc2ccccc12 |t:24|

Quetiapine D4 hemifumarate is the deuterium labeled Quetiapine hemifumarate. Quetiapine hemifumarate is a agonist of 5-HT receptors and a antagonist of dopamine receptor,with ntidepressant and anxiolytic.

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